{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4357343 -0.8426671 5.7802327 ] [ 4.9819098 -0.5497853 1.552005 ] [ 1.4926223 -1.5807 -7.6222547 ] [ -0.7630441 0.9312437 -6.0342701 ] [ -5.2757537 2.0419086 6.324287 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.981233083406535e-10 -1.350101526737336e-09 9.260953694723661e-09 ] [ 7.981899408494405e-09 -8.808531541195143e-10 2.486586126364704e-09 ] [ 2.391444552744724e-09 -2.53256058449856e-09 -1.221219827812292e-08 ] [ -1.222531417659377e-09 1.492016884407289e-09 -9.667966477812477e-09 ] [ -8.452689235239097e-09 3.271498220730459e-09 1.013262477462937e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -23.859811 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.822763136090667e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3675282 0.8556072 2.0918896 ] [ 2.4082452 3.0481735 1.7261638 ] [ 2.6722732 2.2585432 3.7791103 ] [ 3.3631551 1.662887 0.2850023 ] [ 4.2773683 1.9783661 2.2781161 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3675282e-10 8.556072e-11 2.0918896e-10 ] [ 2.4082452e-10 3.0481735e-10 1.7261638e-10 ] [ 2.6722732e-10 2.2585432e-10 3.7791103e-10 ] [ 3.3631551e-10 1.662887e-10 2.850023e-11 ] [ 4.2773683e-10 1.9783661e-10 2.2781161e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.53e-05 -4.15e-05 -2.37e-05 ] [ 1.08e-05 -1.44e-05 -1.15e-05 ] [ -1.06e-05 1.98e-05 2.8e-06 ] [ -1.66e-05 2.29e-05 4.84e-05 ] [ 5.16e-05 1.32e-05 -1.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.655683471424e-14 -6.64903297632e-14 -3.797158591296e-14 ] [ 1.730350750464e-14 -2.307134333952e-14 -1.84250311392e-14 ] [ -1.698307218048e-14 3.172309709184e-14 4.48609453824e-15 ] [ -2.659613190528e-14 3.668984461632e-14 7.754534844671999e-14 ] [ 8.267231363328e-14 2.114873139456e-14 -2.579504359488e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }